SCHEMBL21409497

SCHEMBL21409497

Sc1ccc(OCC2CS2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.35
MMP9 P14780 11/20 0.35
MMP14 P50281 7/20 0.35
MMP3 P08254 4/20 0.35
TDP1 Q9NUW8 2/20 0.33
MMP7 P09237 4/20 0.33
MMP8 P22894 3/20 0.33
MMP1 P03956 2/20 0.33
ADAM17 P78536 1/20 0.33
TP53 P04637 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
TSHR P16473 2/20 0.33
ALDH1A1 P00352 2/20 0.33
PARP15 Q460N3 2/20 0.33
PARP10 Q53GL7 2/20 0.33
PARP2 Q9UGN5 2/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1402783 0.83 FFAR4 (0.38) MMP2MMP9MMP14MMP3TDP1
SCHEMBL2734738 0.80 DRD2 (0.40) MMP2MMP9MMP14MMP3MAPT
SCHEMBL11849761 0.80 LTA4H (0.45) CYP1A2
SCHEMBL2734453 0.79 TDP1 (0.53) MMP2MMP9MMP14MMP3TDP1
SCHEMBL2733964 0.78 MMP2 (0.34) MMP2MMP9MMP14MMP3TDP1
SCHEMBL2734447 0.78 MMP2 (0.34) MMP2MMP9MMP14MMP3TDP1
SCHEMBL3684205 0.76 MEN1 (0.47) MMP2MMP9MMP14MMP3TP53
SCHEMBL1402785 0.76 PKM (0.60) MMP2MMP9MMP14MMP3MMP7
SCHEMBL21409504 0.76 MMP2 (0.35) MMP2MMP9MMP14MMP3MMP7
SCHEMBL1402906 0.76 KMT2A (0.60) MMP2MMP9MMP14MMP3TP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107428040-B Method for manufacturing plastic lens, method for positioning film, and composite body 株式会社HOPNIC研究所 2022-05-31 CN disclosed
CN-112469768-A Method for setting polymerization conditions and method for producing optical material 三井化学株式会社 2021-03-09 CN disclosed
CN-111868099-A Method for setting polymerization conditions and method for producing optical material 三井化学株式会社 2020-10-30 CN disclosed
WO-2020022369-A1 METHOD FOR SETTING POLYMERIZATION CONDITIONS AND METHOD FOR PRODUCING OPTICAL MATERIAL 三井化学株式会社 2020-01-30 WO disclosed
WO-2019187176-A1 METHOD FOR SETTING POLYMERIZATION CONDITIONS AND METHOD FOR PRODUCING OPTICAL MATERIAL 三井化学株式会社 2019-10-03 WO disclosed
CN-1286883-C Polymerizable composition containing novel cyclic sulfur compound and resin obtained by curing the polymerizable composition MITSUI CHEMICALS INC (JP) 2006-11-29 CN disclosed
CN-1596276-A Polymerizable composition comprising novel sulfur-containing cyclic compound and resin obtained by curing the polymerizable composition MITSUI CHEMICALS INC (JP) 2005-03-16 CN disclosed